3-oxidanylidene-4-(4-oxidanylphenoxy)-2-(1H-pyrrol-2-ylcarbonyl)pentanenitrile

Systemtic Name: 3-oxidanylidene-4-(4-oxidanylphenoxy)-2-(1H-pyrrol-2-ylcarbonyl)pentanenitrile Openeye Name: 4-(4-hydroxyphenoxy)-3-oxo-2-(1H-pyrrole-2-carbonyl)pentanenitrile CAS Name: 4-(4-hydroxyphenoxy)-3-oxo-2-[oxo(1H-pyrrol-2-yl)methyl]pentanenitrile IUPAC Name: 4-(4-hydroxyphenoxy)-3-oxo-2-(1H-pyrrole-2-carbonyl)pentanenitrile Traditional Name: 4-(4-hydroxyphenoxy)-3-keto-2-(1H-pyrrole-2-carbonyl)valeronitrile Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C#N)C(=O)C1=CC=CN1)OC2=CC=C(C=C2)O

Isomeric SMILES

CC(C(=O)C(C#N)C(=O)C1=CC=CN1)OC2=CC=C(C=C2)O

InChI

InChI=1S/C16H14N2O4/c1-10(22-12-6-4-11(19)5-7-12)15(20)13(9-17)16(21)14-3-2-8-18-14/h2-8,10,13,18-19H,1H3